HuagongsheHuagongshe Chemistry Print Report · For research reference only
2,5-Hexanediol dibenzoate
Identifiers & Physical Properties
| Molecular formula | C20H22O4 |
|---|---|
| Average molar mass | 326.4 g/mol |
| SMILES | CC(CCC(C)OC(=O)c1ccccc1)OC(=O)c1ccccc1 |
| InChIKey | RXGRLUHNJVKKIT-UHFFFAOYSA-N |
| PubChem CID | 5259446 |
Chemical & Physical Properties
| XLogP | 4.9 |
|---|---|
| Topological polar surface area | 52.6 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 4 |
| Rotatable bonds | 9 |
| Heavy atoms | 24 |
| Formal charge | 0 |
| Complexity | 356 |